[(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: [(1R)-1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid [(2R)-1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid [(1R)-2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C(C)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)[C@H](C)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H20N2O4/c1-15(22(26)25-21-9-5-7-18-6-3-4-8-20(18)21)29-23(27)16(2)28-19-12-10-17(14-24)11-13-19/h3-13,15-16H,1-2H3,(H,25,26)/t15-,16+/m1/s1